4.8 Article

Magnetic order-dependent phonon properties in 2D magnet CrI3

Journal

NANOSCALE
Volume 13, Issue 24, Pages 10882-10890

Publisher

ROYAL SOC CHEMISTRY
DOI: 10.1039/d1nr00820j

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Funding

  1. Graduate School of Xidian University

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The study investigated how spin affects the phononic properties of CrI3 monolayers, finding that infrared spectra can be used to identify magnetic order and explaining the mechanisms behind thermal expansion coefficients and lattice thermal conductivity being influenced by magnetic phases. This research provides insights into spin-lattice coupling and highlights the potential of spintronic monolayers as thermal switching devices for active heat flow control.
We carried out a systematic theoretical study on how spin affects the phononic properties of CrI3 monolayers. We find that the frequencies of two infrared-active (IR) modes are significantly influenced by the magnetic configuration. Thus an IR spectrum may be applied to identify the magnetic order by utilizing the spin-lattice correlation. The thermal expansion coefficients are 2.21, 3.35 and -5.58 x 10(-6) K-1 for ferromagnetic (FM), antiferromagnetic (AFM) and paramagnetic (PM) phases at 30 K, because of the competition between the modes with negative and positive Gruneisen constants. Furthermore, the lattice thermal conductivity is also sensitive to the magnetic phase, which is attributed to the spin-dependent lattice anharmonicity. Our results provide fundamental insights into the spin-lattice coupling and clarify the potential of a spintronic monolayer as a thermal switching device for active heat flow control.

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